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Conferences > LS > 2021 > JTh5A > JTh5A.31

Modeling Ultrafast Anharmonic Vibrational Coupling in Gas-Phase Fluorobenzene Molecules

Aldair Alejandro, Emma E. Nelson, Eric T. Sevy, and Jeremy A. Johnson

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Abstract

We use first-principles calculations to model ultrafast anharmonic coupling in gas-phase fluorobenzene after excitation with a multi-THz pump. Understanding intramolecular energy flow is crucial to understanding collisional energy transfer.

© 2021 The Author(s)

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